SCHEMBL7686522

SCHEMBL7686522

CN(C)C1CCN(CCn2c(COc3ccc(Cl)cc3)nc3ccccc32)CC1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 11/20 0.64
TP53 P04637 3/20 0.59
MAPT P10636 2/20 0.52
CYP2D6 P10635 1/20 0.52
HRH1 P35367 1/20 0.52
KCNH2 Q12809 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7685702 0.94 NPY1R (0.74) NPY1RTP53MAPTSMN1; SMN2
SCHEMBL7689103 0.85 NPY1R (0.60) NPY1R
SCHEMBL7682626 0.82 NPY1R (0.56) NPY1R
SCHEMBL7684368 0.81 NPY1R (0.55) NPY1R
SCHEMBL7962026 0.81 NPY1R (0.74) NPY1R
SCHEMBL7684732 0.79 NPY1R (1.00) NPY1RTP53MAPTCYP2D6HRH1
SCHEMBL7692591 0.77 NPY1R (0.81) NPY1RTP53MAPTSMN1; SMN2
SCHEMBL7956883 0.76 NPY1R (0.78) NPY1R
SCHEMBL7690343 0.74 NPY1R (0.71) NPY1RTP53MAPTSMN1; SMN2
SCHEMBL7951612 0.74 NPY1R (0.71) NPY1RTP53MAPTSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020007071-A1 Benzimidzolyl neuropeptide Y receptor antagonists BRITTON THOMAS CHARLES (US) 2002-01-17 US disclosed
US-6255494-B1 SUBSTITUTED BENZIMIDAZOLES USEFUL IN TREATING OR PREVENTING CONDITIONS ASSOCIATED WITH EXCESS OF NEUROPEPTIDE Y (AROUND ARTERIES IN HEART, RESPIRATORY TRACT, GASTROINTESTINAL TRACT AND GENITOURINARY TRACT); ETIOLOGY OF PSYCHIATRIC DISORDERS ELI LILLY AND COMPANY 2001-07-03 US disclosed
EP-0871442-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997025041-A1 BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-07-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020007071-A1 Benzimidzolyl neuropeptide Y receptor antagonists NPY1R, NPY2R, NPY5R NPY1R 1/4885TP53 4432/4885MAPT 3175/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.